Sodium ion → 4-Bromo-2-isopropyl-7-(2-methylsulfanyl-ethylsulfanyl)-2H-phthalazin-1-one
Reaction equation
[CH3:19][S:20][CH2:21][CH2:22][Cl:23].[H-:18].[Na+:17].[O:24]=[CH:25][N:26]([CH3:27])[CH3:28].[SH:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([Br:16])[n:7][n:8]([CH:13]([CH3:14])[CH3:15])[c:9](=[O:12])[c:10]2[cH:11]1>>[S:1]([c:2]1[cH:3][cH:4][c:5]2[c:6]([Br:16])[n:7][n:8]([CH:13]([CH3:14])[CH3:15])[c:9](=[O:12])[c:10]2[cH:11]1)[CH2:22][CH2:21][S:20][CH3:19]Participants
6
Sources & evidence
- ORD record
- ord-ab8a8e4cb31c49b1b18f9109621d5024
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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